MolNFT v1 · #105660 · protein

Crystal structure of repressor of toxin (rot), a central regulator of staphylococcus aureus virulence

4RBR · Hth-type transcriptional regulator rot: “Crystal structure of repressor of toxin (rot), a central regulator of staphylococcus aureus virulence”. X-ray diffraction, 1 ligand (CL), 1 pocket (best druggability 0.26). MolNFT v1 #105660…

PDB: 4RBR
Type: protein
Length: 262 residues
Chains: 2
Method: x-ray diffraction
Collection: MolNFT v1 / PDB
Contract: 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
Owner: 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
Molecule: Hth-type transcriptional regulator rot
UniProt: T1YAC1
Ligands: CL
Pockets: 1 · best druggability 0.26

Structure

x-ray diffraction · 1 distinct chain · 71% helix, 8% strand (DSSP).

Chain	Molecule	Type	Residues	Secondary structure	UniProt
A, B	Hth-type transcriptional regulator rot	protein	131	71% helix, 8% strand	T1YAC1

Ligands and binding sites

CL · Chloride ion · ion · 2 copies · chains A, B

Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.

Pockets

1 pocket found on a 1 Å grid, 0 with a druggability of 0.5 or more.

Pocket	Volume (Å³)	Druggability	Buriedness	Lining residues	Inside
1	56	0.26	0.72	14	empty

Interfaces

1 interface between chains.

A–B · 1766 Å² buried · 16 hydrogen bonds · protein-protein

Compared structures

4RBR · Crystal structure of Repressor of Toxin (Rot), a central regulator of Staphylococcus… · the same entry in another collection · chain A against A, TM-score 1.00

Analyse

Open in the research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides and crosslinks on the 3D structure
Every structure of UniProt T1YAC1
Elsewhere: RCSB PDB 4RBR · PDBe 4RBR · UniProt T1YAC1

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